Cas no 20997-52-8 (5alpha-Cholestan-3alpha-ol, 2alpha-methyl-, acetate)
20997-52-8 structure
Product Name:5alpha-Cholestan-3alpha-ol, 2alpha-methyl-, acetate
CAS No:20997-52-8
MF:C30H52O2
MW:444.732689857483
CID:2656763
Update Time:2023-08-06
5alpha-Cholestan-3alpha-ol, 2alpha-methyl-, acetate Chemical and Physical Properties
Names and Identifiers
-
- 2α-Methyl-5α-cholestan-3α-ol acetate
- RCMCMFZHMFLBFA-NNTQYPLXSA-N
- 2-Methylcholestan-3-yl acetate #
- 2alpha-Methyl-5alpha-cholestan-3alpha-ol acetate
- 5.alpha.-Cholestan-3.alpha.-ol, 2.alpha.-methyl-, acetate
- 5alpha-Cholestan-3alpha-ol, 2alpha-methyl-, acetate
-
- Inchi： 1S/C30H52O2/c1-19(2)9-8-10-20(3)25-13-14-26-24-12-11-23-17-28(32-22(5)31)21(4)18-30(23,7)27(24)15-16-29(25,26)6/h19-21,23-28H,8-18H2,1-7H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-,30+/m1/s1
- InChI Key： RCMCMFZHMFLBFA-NNTQYPLXSA-N
- SMILES： O(C(C)=O)[C@@H]1[C@H](C)C[C@@]2(C)[C@H](C1)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@H]21
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 32
- Rotatable Bond Count: 7
- Complexity: 670
- Topological Polar Surface Area: 26.3
5alpha-Cholestan-3alpha-ol, 2alpha-methyl-, acetate Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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